2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone

C18H20O2 — CID 106790381

IUPAC2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone
SMILESCOc1cc(C)ccc1C(=O)Cc1cc(C)cc(C)c1
InChIInChI=1S/C18H20O2/c1-12-5-6-16(18(10-12)20-4)17(19)11-15-8-13(2)7-14(3)9-15/h5-10H,11H2,1-4H3
InChIKeyRHGMUNJTTFDQAH-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.05
Rot. Bonds4

About 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone

2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone (PubChem CID 106790381) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone
PubChem CID106790381
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone
SMILESCOc1cc(C)ccc1C(=O)Cc1cc(C)cc(C)c1
InChIInChI=1S/C18H20O2/c1-12-5-6-16(18(10-12)20-4)17(19)11-15-8-13(2)7-14(3)9-15/h5-10H,11H2,1-4H3
InChIKeyRHGMUNJTTFDQAH-UHFFFAOYSA-N
XLogP4.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-2-methoxyphenyl)-2-(3,5-dimethylphenyl)ethanone
CID 114963290
2-(3-bromophenyl)-1-(2-methoxy-4-methylphenyl)ethanone
CID 106790334
1-(2,4-dimethoxyphenyl)-2-(3-methylphenyl)ethanone
CID 62387371
2-(3-bromo-4-fluorophenyl)-1-(2-methoxy-4-methylphenyl)ethanone
CID 106790005
1-(2,6-dimethoxyphenyl)-2-(3,5-dimethylphenyl)ethanone
CID 116809971
2-[2-(2-methoxyethoxy)ethoxy]-1-(2-methoxy-4-methylphenyl)ethanone
CID 104563929
1-(2-methoxy-4-methylphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 106790241
1-(2-methoxy-4-methylphenyl)-2-(4-methylpiperazin-1-yl)ethanone
CID 43794429
1-(4-chloro-2-methoxyphenyl)-2-(4-chlorophenyl)ethanone
CID 63526993
1-(2-methoxy-4-methylphenyl)-2-prop-2-enoxyethanone
CID 62029110
1-(2-methoxy-4-methylphenyl)-5,5-dimethylhexan-1-one
CID 114209847
1-(4,5-dimethoxy-2-methylphenyl)-2-(3-methylphenyl)ethanone
CID 62389766

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone?
The IUPAC name of 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone (CID 106790381) is 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone?
The canonical SMILES for 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone is COc1cc(C)ccc1C(=O)Cc1cc(C)cc(C)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone?
The InChIKey is RHGMUNJTTFDQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-12-5-6-16(18(10-12)20-4)17(19)11-15-8-13(2)7-14(3)9-15/h5-10H,11H2,1-4H3.
What are the key properties of 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone?
2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone has a molecular weight of 268.36 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethanone is sourced from PubChem (CID 106790381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).